2-{[3-nitro-4-(piperidin-1-yl)phenyl]methylidene}hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-{[3-nitro-4-(piperidin-1-yl)phenyl]methylidene}hydrazine-1-carbothioamide
2-{[3-nitro-4-(piperidin-1-yl)phenyl]methylidene}hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | 8006-6919 |
| Compound Name: | 2-{[3-nitro-4-(piperidin-1-yl)phenyl]methylidene}hydrazine-1-carbothioamide |
| Molecular Weight: | 307.37 |
| Molecular Formula: | C13 H17 N5 O2 S |
| Smiles: | C1CCN(CC1)c1ccc(/C=N/NC(N)=S)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7779 |
| logD: | 2.7779 |
| logSw: | -3.392 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.279 |
| InChI Key: | VLBPUEZVYOLBRT-UHFFFAOYSA-N |